기본 정보
- 표준 SMILES
Nc1cc(Cl)ccc1O- InChIKey
SWFNPENEBHAHEB-UHFFFAOYSA-N- 분자식
- C6H6ClNO
- 평균 분자량
- 143.57 g/mol
- 단동위원소 질량
- 143.01379149
개요
2-Amino-4-Chlorophenol can cause cancer according to California Labor Code.
이름 및 식별자
- 우선 이름
- 2-Amino-4-chlorophenol
- IUPAC
- 2-amino-4-chlorophenol
- 현지명
- 2-아미노-4-클로로페놀
- 영어명
- 2-Amino-4-chlorophenol
- 분자식
- C6H6ClNO
- 분자량
- 143.57
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
95-85-2- PubChem CID
- 7265
- DTXSID
DTXSID5024473- ChEMBL
CHEMBL251389- UNII
- 2Z43LEA3DX
- EC Number
- 202-458-9
- Nikkaji
- J31.070K
물성
구조 계산 물성
- XLogP
- 1.8
- 극성 표면적
- 46.3 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 0
- 무거운 원자 수
- 9
- 형식 전하
- 0
- 복잡도
- 99.1
실험 및 물리화학적 성질
Cosmetics
Cosmetic ingredients (4-Chloro-2-Aminophenol) -> CIR (Cosmetic Ingredient Review)
Hair dyeing
LogP
1.24
1.81
Solubility
less than 1 mg/mL at 68 °F (NTP, 1992)
Solubility in water, g/l at 26 °C: 3 (slightly soluble)
Melting Point
284 to 286 °F (decomposes) (NTP, 1992)
140 °C
Vapor Pressure
0.00141 [mmHg]
Vapor pressure, Pa at 25 °C: 0.2
Physical Description
2-Amino-4-chlorophenol is a light brown colored crystalline solid. It may be toxic by ingestion. It is insoluble in water. It is used to make other chemicals.
Brown solid; [ICSC] Brown powder; [Alfa Aesar MSDS]
BROWN CRYSTALLINE POWDER WITH CHARACTERISTIC ODOUR.
물리화학적 성질
- 녹는점
- 136 · 136-141 °C(lit.)
- 끓는 점
- 185.5 °C · 185.5°C (rough estimate)
- 밀도
- 1.2028 · 1.2028 (rough estimate)
- 굴절률
- 1.5618 · 1.5618 (estimate)
- 저장 조건
- 2 · 2-8°C
- 용해도
- 2.3 g/L · 2.3g/L
- 산도 계수 (pKa)
- 9.31 · 9.31±0.18(Predicted)
- 물리적 상태
- 고체
- 색상
- 옅은 오렌지색에서 밝은 갈색까지
- 수용성
- 20 °C에서 · 불용성. 20°C에서 <0.1g/100mL
- BRN
- 774859 · 774859
- 안정성
- 안정적인. 강한 산화제와 호환되지 않습니다.
- 화장품 원료 기능
- 머리 염색
- InChI
- 1S/C6H6ClNO/c7-4-1-2-6(9)5(8)3-4/h1-3,9H,8H2
- InChIKey
- SWFNPENEBHAHEB-UHFFFAOYSA-N
- SMILES
- Nc1cc(Cl)ccc1O
- NIST
- 5 · 5-Chloro-2-hydroxyaniline(95-85-2)
- EPA
- 2 · 2-Amino-4-chlorophenol (95-85-2)
화학적 성질
2-Amino-4-chlorophenol is a grayish to light brown crystalline solid or powder
안전 및 규제
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 15.5% (15 of 97) of reports.
Warning
H302 (84.5%): Harmful if swallowed [Warning Acute toxicity, oral]
P203, P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 97 reports by companies from 12 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Danger
유해성 정보
Regulatory Information
Chemical: Phenol, 2-amino-4-chloro-
Hazard Traits - Carcinogenicity
Status: Active Update: 23-11-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/10289
4-Chloro-2-aminophenol: Does not have an individual approval but may be used under an appropriate group standard
The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)
Fire Hazards
Excerpt from ERG Guide 151 [Substances - Toxic (Non-Combustible)]:
· Non-combustible, substance itself does not burn but may decompose upon heating to produce corrosive and/or toxic fumes.
Combustible. Gives off irritating or toxic fumes (or gases) in a fire.
Health Hazards
Excerpt from ERG Guide 151 [Substances - Toxic (Non-Combustible)]:
· Highly toxic, may be fatal if inhaled, ingested or absorbed through skin.
안전 및 보호
Fire Fighting
Excerpt from ERG Guide 151 [Substances - Toxic (Non-Combustible)]:
Use water spray, foam, powder, carbon dioxide.
First Aid Measures
Fresh air, rest. Seek medical attention if you feel unwell.
Wear protective gloves when administering first aid. Remove contaminated clothes. Rinse and then wash skin with water and soap.
Rinse with plenty of water for several minutes (remove contact lenses if easily possible).
Rinse mouth. Refer for medical attention .
Accidental Release Measures
· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.
· Do not touch damaged containers or spilled material unless wearing appropriate protective clothing.
First Aid
EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.
General First Aid:
Spillage Disposal
Personal protection: particulate filter respirator adapted to the airborne concentration of the substance, protective clothing and protective gloves. Sweep spilled substance into covered containers. If appropriate, moisten first to prevent dusting. Carefully collect remainder. Then store and dispose of according to local regulations.
Isolation and Evacuation
Excerpt from ERG Guide 151 [Substances - Toxic (Non-Combustible)]:
Immediate precautionary measure
독성 정보
Toxicity Summary
The CIR Expert Panel concludes that the available data support the safety of 6-Amino-m-Cresol, 4-Amino-m-Cresol, 5-Amino-4-Chloro-o-Cresol and 5-Amino-6-Chloro-o-Cresol as used in oxidative and nonoxidative (semipermanent) for dyes. The available data also support the safety of 6-Amino-o-Cresol and 4-Chloro-2-Aminophenol for use in oxidative hair dyes, but are insufficient to support the safety of 6-Amino-o-Cresol and 4-Chloro-2-Aminophenol and nonoxidative (semipermanent) hair dyes.
Safe for use in cosmetics, with qualifications
Signs and Symptoms
See Effects of short-term exposure.
Redness.
Redness.
Carcinogen Classification
2-Amino-4-chlorophenol
Group 2B: Possibly carcinogenic to humans
Volume 123: (2020) Some Nitrobenzenes and Other Industrial Chemicals
2020 online
2018
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- SJ5700000
- ridadr
- UN 2673
- HS 번호
- 29222900
- risk_code
- 22-36/37/38-20/21/22
- hazard_code
- Xn
- safety_code
- 26-36-36/37/39
- 포장분류
- II
- 위험 등급
- 6.1
- 기존화학 물질
- KE-05510
- Hazard Classifications
- Acute Tox. 4 OralCarc. 2
- 스토리지 클래스
- 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
화학 및 산업
용도 및 제조
Uses
CIR ingredient: 4-Chloro-2-Aminophenol
Used as an intermediate; [NTP]
응용 분야
용도Intermediate.
일반 설명5-Chloro-2-hydroxyaniline is a light brown colored crystalline solid. 5-Chloro-2-hydroxyaniline may be toxic by ingestion. 5-Chloro-2-hydroxyaniline is insoluble in water. 5-Chloro-2-hydroxyaniline is used to make other chemicals.
상·하류 제품 정보
상류 원료
하류 제품
공급사50 곳
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